2-Desbenzoyl-2-tiglyl Docetaxel

Basic Information

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CAS Number

1887057-05-7

Molecular Formula

C41H55NO14

Molecular Weight

785.87 g/mol

Chemical Classification

Basic Chemical Raw Materials Organic Chemicals Carboxylic Acids

Basic Chemical Raw Materials Organic Chemicals Ketones

Basic Chemical Raw Materials Organic Chemicals Esters

Basic Chemical Raw Materials Organic Chemicals Ethers

Basic Chemical Raw Materials Organic Chemicals Heterocyclic Compounds

Pharmaceutical Chemicals Pharmaceutical Intermediates Heterocyclic Intermediates

Fine Chemicals Dyes and Pigments Organic Dyes

Fine Chemicals Surfactants Anionic Surfactants

Laboratory Chemicals Research Chemicals Biochemical Reagents

Basic Physical Properties

SMILES

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O1C[C@@]2([C@H]1C[C@@H]([C@@]1(C)C([C@@H](C3=C(C)[C@H](C[C@](C3(C)C)([C@H]([C@H]21)OC(/C(=C/C)/C)=O)O)OC([C@@H]([C@H](C1C=CC=CC=1)NC(=O)OC(C)(C)C)O)=O)O)=O)O)OC(C)=O

InChI

1S/C41H55NO14/c1-11-20(2)34(48)54-33-31-39(10,25(44)17-26-40(31,19-52-26)55-22(4)43)32(47)29(45)27-21(3)24(18-41(33,51)38(27,8)9)53-35(49)30(46)28(23-15-13-12-14-16-23)42-36(50)56-37(5,6)7/h11-16,24-26,28-31,33,44-46,51H,17-19H2,1-10H3,(H,42,50)/b20-11+/t24-,25-,26+,28-,29+,30+,31-,33-,39+,40-,41+/m0/s1

InChIKey

AOEGVETYSHPGBP-XYIDDFOTSA-N

LogP

2.9120000000000026

Topological Polar Surface Area

224.44999999999996 Å²

Hydrogen Bond Donor/Acceptor

5 / 15

Complexity

1660

Synonyms & References

English

2-O-desbenzoyl-2-O-tiglyldocetaxel
JZ14779AZJ
Q27281749
(2aR,4S,4aS,6R,9S,11S,12S,12aR,12bS)-12b-acetoxy-9-(((2R,3S)-3-((tert-butoxycarbonyl)amino)-2-hydroxy-3-phenylpropanoyl)oxy)-4,6,11-trihydroxy-4a,8,13,13-tetramethyl-5-oxo-2a,3,4,4a,5,6,9,10,11,12,12a,12b-dodecahydro-1H-7,11-methanocyclodeca[3,4]benzo[1,2-b]oxet-12-yl (E)-2-methylbut-2-enoate

FAQ

What is 2-Desbenzoyl-2-tiglyl Docetaxel (CAS: 1887057-05-7)?

2-Desbenzoyl-2-tiglyl Docetaxel is a semi-synthetic derivative of Docetaxel, an anti-cancer drug. It has the chemical formula C49H56NO15 and is used in pharmaceutical research and development for potential cancer treatments.

What are the main uses of 2-Desbenzoyl-2-tiglyl Docetaxel (CAS: 1887057-05-7)?

2-Desbenzoyl-2-tiglyl Docetaxel is primarily used in pharmaceutical research for developing new anti-cancer drugs. It is also studied for its potential to enhance the efficacy of existing chemotherapy treatments.

Is 2-Desbenzoyl-2-tiglyl Docetaxel (CAS: 1887057-05-7) safe?

2-Desbenzoyl-2-tiglyl Docetaxel is generally safe when handled properly. However, it is important to follow all safety guidelines and use appropriate protective equipment, as it may cause skin irritation and other adverse reactions. Always consult a qualified chemist or pharmacist for specific safety information.

How should 2-Desbenzoyl-2-tiglyl Docetaxel (CAS: 1887057-05-7) be stored?

2-Desbenzoyl-2-tiglyl Docetaxel should be stored in a cool, dry place away from direct sunlight. It should be kept in a tightly sealed container to prevent degradation. The optimal storage temperature is between 15°C and 25°C (59°F and 77°F) to ensure its stability and effectiveness.